5X5O

Crystal structure of ZAK in complex with compound D2829

Summary for 5X5O

• Entry DOI: 10.2210/pdb5x5o/pdb
• Descriptor: Mitogen-activated protein kinase kinase kinase MLT, N-[2,4-bis(fluoranyl)-3-[2-(3-methoxy-1H-pyrazolo[3,4-b]pyridin-5-yl)ethynyl]phenyl]-3-bromanyl-benzenesulfonamide (3 entities in total)
• Functional Keywords: zak, kinase, inhibitor, transferase
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm : Q9NYL2
• Total number of polymer chains: 1
• Total formula weight: 35856.82

Authors

Dai, Y.B.,Zhao, P.,Yun, C.H. (deposition date: 2017-02-17, release date: 2017-12-27, Last modification date: 2024-03-27)

• Primary citation: Chang, Y.,Lu, X.,Shibu, M.A.,Dai, Y.B.,Luo, J.,Zhang, Y.,Li, Y.,Zhao, P.,Zhang, Z.,Xu, Y.,Tu, Z.C.,Zhang, Q.W.,Yun, C.H.,Huang, C.Y.,Ding, K.; Structure Based Design of N-(3-((1H-Pyrazolo[3,4-b]pyridin-5-yl)ethynyl)benzenesulfonamides as Selective Leucine-Zipper and Sterile-alpha Motif Kinase (ZAK) Inhibitors.; J. Med. Chem., 60:5927-5932, 2017; PubMed: 28586211; DOI: 10.1021/acs.jmedchem.7b00572

Experimental method

X-RAY DIFFRACTION (1.868 Å)